2-Bupranolol-succinyl-1,3-dipalmitoylglycerol
TL;DR: 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol (CAS 6302-12-1) is a chemical compound with molecular formula C53H93Cl2NO9 and molecular weight 957.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-[1-(tert-butylamino)-3-(2-chloro-5-methylphenoxy)propan-2-yl] 4-O-[1,3-di(hexadecanoyloxy)propan-2-yl] butanedioate;hydrochloride
Also Known As: DPSB, KST-1A9433, 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol, 1,3-bis(hexadecanoyloxy)propan-2-yl 1-(tert-butylamino)-3-(2-chloro-5-methylphenoxy)propan-2-yl butanedioate hydrochloride(1:1), 2-((1-(2-Chloro-5-methylphenoxy)-3-tert-butylamino-2-propoxy)succinyl)-1,3-dipalmitoylglyceroyl
| Molecular Formula | C53H93Cl2NO9 |
|---|---|
| Molecular Weight | 957.62 g/mol |
| LogP | 14.48992 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 47 |
| Exact Mass | 957.62274 |
| Heavy Atoms | 65 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 6302-12-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCC(=O)OC(CNC(C)(C)C)COC1=C(C=CC(=C1)C)Cl.Cl |
| InChIKey | SHTNCSPEDGTLDP-UHFFFAOYSA-N |
Product Overview
2-Bupranolol-succinyl-1,3-dipalmitoylglycerol (CAS 6302-12-1), with molecular formula C53H93Cl2NO9 and molecular weight 957.62 g/mol. IUPAC: 1-O-[1-(tert-butylamino)-3-(2-chloro-5-methylphenoxy)propan-2-yl] 4-O-[1,3-di(hexadecanoyloxy)propan-2-yl] butanedioate;hydrochloride.
Chemical Property Profile of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol
Property Insights of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol
The XLogP value of 14.48992 indicates that 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol. Following Lipinski's Rule of Five, 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol?
The CAS number of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol is 6302-12-1.
What is the molecular formula of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol?
The molecular formula of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol is C53H93Cl2NO9.
What is the molecular weight of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol?
The molecular weight of 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol is 957.62 g/mol.
Where can I buy 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol?
You can request a quote for 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol?
Yes, KEHONG BIO provides custom synthesis services for 2-Bupranolol-succinyl-1,3-dipalmitoylglycerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.